Vitas-M small molecule compound
ethyl 2-{[3-(4-benzylpiperazin-1-yl)quinoxalin-2-yl]amino}-4,5-dimethylthiophene-3-carboxylate
Catalog ID
STK544517
SMILES CCOC(=O)c1c(Nc2nc3ccccc3nc2N2CCN(CC2)Cc2ccccc2)sc(c1C)C
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C28H31N5O2S MW 501.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H31N5O2S/c1-4-35-28(34)24-19(2)20(3)36-27(24)31-25-26(30-23-13-9-8-12-22(23)29-25)33-16-14-32(15-17-33)18-21-10-6-5-7-11-21/h5-13H,4,14-18H2,1-3H3,(H,29,31)InChIKey
COALJMBDKOLDLO-UHFFFAOYSA-NSynonyms
488101-78-6488101786
CCOC(=O)C1=C(SC(=C1C)C)NC2=NC3=CC=CC=C3N=C2N4CCN(CC4)CC5=CC=CC=C5
ethyl2((3(4benzylpiperazin1yl)quinoxalin2yl)amino)45dimethylthiophene3carboxylate
InChI=1SC28H31N5O2Sc143528(34)2419(2)20(3)3627(24)312526(302313981222(23)2925)33161432(151733)1821106571121h513H41418H213H3(H2931)
MFCD03288606
ZINC000057061371
ZINC57061371
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